[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 4-pyrazol-1-ylbenzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 4-pyrazol-1-ylbenzoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid [2-keto-2-(2-thenoylamino)ethyl] ester Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)C3=CC=CS3

InChI

InChI=1S/C17H13N3O4S/c21-15(19-16(22)14-3-1-10-25-14)11-24-17(23)12-4-6-13(7-5-12)20-9-2-8-18-20/h1-10H,11H2,(H,19,21,22)